Molecule

terpendole J

AlkaPlorer ID: AK061589

Synonym: 'Terpendole J', 'FO 2546E'

IUPAC Name: (1R,2R,5S,7S,8R,9R,11S,12S,15S)-1,2-dimethyl-7-[2-(3-methylbut-2-enoxy)propan-2-yl]-6,10-dioxa-24-azaheptacyclo[13.10.0.02,12.05,11.09,11.017,25.018,23]pentacosa-17(25),18,20,22-tetraene-8,12-diol

Structure

SMILES: CC(C)=CCOC(C)(C)[C@H]1O[C@H]2CC[C@@]3(C)[C@@](O)(CC[C@H]4CC5=C(NC6=CC=CC=C56)[C@]43C)[C@]23O[C@@H]3[C@@H]1O

InChI: InChI=1S/C32H43NO5/c1-18(2)13-16-36-28(3,4)26-24(34)27-32(38-27)23(37-26)12-14-29(5)30(6)19(11-15-31(29,32)35)17-21-20-9-7-8-10-22(20)33-25(21)30/h7-10,13,19,23-24,26-27,33-35H,11-12,14-17H2,1-6H3/t19-,23-,24+,26-,27+,29+,30-,31-,32-/m0/s1

InChIKey: GLVMTITYOKYZRQ-RSQOGWKASA-N

Reference

Terpendoles, Novel ACAT Inhibitors Produced by Albophoma yamanashiensis. III. Production, Isolation and Structure Elucidation of New Components.

PubChem CID: 163003852

LOTUS: LTS0021067

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Albophoma yamanashiensis	Albophoma	Ophiocordycipitaceae	Hypocreales	Sordariomycetes	Ascomycota	Fungi	Eukaryota

Properties Information

Molecule Weight: 521.6980000000003

TPSA？: 87.24

MolLogP？: 4.950200000000005

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 7

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi